Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:27:52 UTC
Update Date2025-03-25 01:26:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02403569
Frequency0.5
Structure
Chemical FormulaC5H9ClO2
Molecular Mass136.0291
SMILESCCCC(O)C(=O)Cl
InChI KeyADPBRMNKNQAULI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyl chlorides
  • carbonyl compounds
  • chlorohydrins
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • chlorohydrin
  • halohydrin
  • organochloride
  • monosaccharide
  • organohalogen compound
  • acyl halide
  • organic oxide
  • acyl chloride
  • secondary alcohol
  • hydrocarbon derivative